Elephant’s Toothpaste Used as a Qualitative Demonstration of Rate versus Temperature von Ruekberg, Ben, Freeman, David L

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Proton disorder and the dielectric constant of type II clathrate hydrates von Rick, Steven W., Freeman, David L.

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A(nother) Modification of the Ammonia Fountain Demonstration von Ruekberg, Ben, Freeman, David L

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Rare-event sampling: occupation-based performance measures for parallel tempering and infinite swapping Monte Carlo methods von Doll, J D, Plattner, Nuria, Freeman, David L, Liu, Yufei, Dupuis, Paul

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A constant entropy increase model for the selection of parallel tempering ensembles von Sabo, Dubravko, Meuwly, Markus, Freeman, David L, Doll, J D

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Monte Carlo investigation of the thermodynamic properties of (H2O)n and (H2O)nH2 (n = 2-20) clusters von Holden, Glen L, Freeman, David L

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Phase changes in 38-atom Lennard-Jones clusters. I. A parallel tempering study in the canonical ensemble von Neirotti, J. P., Calvo, F., Freeman, David L., Doll, J. D.

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Phase changes in 38-atom Lennard-Jones clusters. II. A parallel tempering study of equilibrium and dynamic properties in the molecular dynamics and microcanonical ensembles von Calvo, F., Neirotti, J. P., Freeman, David L., Doll, J. D.

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The thermodynamic and ground state properties of the TIP4P water octamer von Asare, E, Musah, A-R, Curotto, E, Freeman, David L, Doll, J D

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A stereographic projection path integral study of the coupling between the orientation and the bending degrees of freedom of water von Curotto, E, Freeman, David L, Doll, J D

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Phase changes in selected Lennard-Jones X13-nYn clusters von Sabo, Dubravko, Predescu, Cristian, Doll, J D, Freeman, David L

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Pressure dependent study of the solid-solid phase change in 38-atom Lennard-Jones cluster von Sabo, Dubravko, Freeman, David L, Doll, J D

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Taming the rugged landscape: production, reordering, and stabilization of selected cluster inherent structures in the X13-nYn system von Sabo, Dubravko, Doll, J D, Freeman, David L

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Combining smart darting with parallel tempering using Eckart space: application to Lennard-Jones clusters von Nigra, Pablo, Freeman, David L, Doll, J D

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Broken-symmetry unrestricted hybrid density functional calculations on nickel dimer and nickel hydride von Diaconu, Cristian V, Cho, Art E, Doll, J D, Freeman, David L

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On the encapsulation of nickel clusters by molecular nitrogen von Nigra, Pablo, Freeman, David L, Sabo, Dubravko, Doll, J D

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COMPUTATIONAL STUDIES OF CLUSTERS:Methods and Results von Freeman, David L., Doll, J. D.

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Monte Carlo Investigation of the Thermodynamic Properties of (H 2 O) n and (H 2 O) n H 2 ( n = 2−20) Clusters von Holden, Glen L., Freeman, David L.

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Dimensional Strategies and the Minimization Problem:  Barrier-Avoiding Algorithms von Faken, Daniel B, Voter, A. F, Freeman, David L, Doll, J. D

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Convergence characteristics of the cumulant expansion for Fourier path integrals von Kunikeev, Sharif D, Freeman, David L, Doll, J D

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